%chk=000259036.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000259036

0 1
O 5.338457 -0.302473 0.470934
O -0.652318 -3.434733 0.470941
C 2.009661 0.389667 -0.012573
C 0.958488 -0.684354 -0.482873
C -0.342646 -0.421221 0.267346
C -0.848517 0.978485 -0.239239
C -2.337792 1.000868 0.220905
C 1.516476 1.797083 -0.417745
C 3.282270 -0.117110 -0.765619
C 0.115596 2.091531 0.167293
C 1.708960 -2.012115 -0.333882
C 3.169033 -1.666110 -0.704424
C -1.577723 -1.280173 0.094163
C -2.686377 -0.500964 0.098461
C 2.269009 0.353837 1.502196
C -3.240143 1.807746 -0.733128
C -2.504961 1.463268 1.669581
C 4.579347 0.395675 -0.163057
C -4.730080 1.497309 -0.515602
C -4.083974 -0.877885 -0.040109
C -1.545025 -2.748798 0.016053
C -5.021227 0.037099 -0.336255
C 4.890878 1.846410 -0.425380
H 0.763802 -0.539464 -1.575813
H -0.125560 -0.392261 1.368638
H -0.860480 0.950670 -1.360486
H 1.483741 1.885062 -1.519170
H 2.237264 2.565141 -0.075444
H 3.236587 0.210759 -1.828973
H 0.176424 2.181776 1.267733
H -0.247374 3.068541 -0.199259
H 1.289940 -2.799135 -0.980924
H 1.626093 -2.413219 0.692844
H 3.872628 -2.075950 0.046335
H 3.454574 -2.111847 -1.669264
H 1.333286 0.402878 2.073610
H 2.772122 -0.575705 1.802816
H 2.901234 1.183920 1.829679
H -2.970580 1.574736 -1.782462
H -3.054853 2.889580 -0.604715
H -3.531424 1.308580 2.022073
H -1.844588 0.908277 2.346871
H -2.271916 2.527389 1.778475
H -5.316093 1.897981 -1.368344
H -5.100316 2.041458 0.381451
H -4.333807 -1.929650 0.095646
H -2.407950 -3.214468 -0.493663
H -6.069878 -0.241439 -0.450254
H 5.198193 2.004173 -1.466367
H 4.025010 2.496416 -0.232291
H 5.719927 2.191455 0.209172


%chk=000259036-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000259036

0 1
O 5.316066 0.104175 0.697633
O -0.748456 -3.594163 0.143920
C 2.025611 0.404262 0.134291
C 1.010542 -0.711954 -0.346739
C -0.369570 -0.478933 0.307751
C -0.861093 0.941902 -0.138627
C -2.377215 0.962992 0.219328
C 1.502449 1.819047 -0.236121
C 3.301796 -0.069835 -0.679209
C 0.070257 2.075017 0.320561
C 1.810725 -2.023965 -0.168694
C 3.281052 -1.626408 -0.529525
C -1.614400 -1.325629 -0.003410
C -2.739341 -0.504938 -0.066831
C 2.315742 0.333146 1.658508
C -3.234089 1.896279 -0.674735
C -2.622373 1.272119 1.726211
C 4.614864 0.578732 -0.238623
C -4.751200 1.614090 -0.518181
C -4.130017 -0.847510 -0.325298
C -1.698473 -2.783543 -0.077536
C -5.072180 0.133472 -0.514533
C 5.055771 1.831999 -0.989074
H 0.876318 -0.555127 -1.441914
H -0.227116 -0.504189 1.410085
H -0.819812 0.924781 -1.252599
H 1.473996 1.920720 -1.342073
H 2.190157 2.599144 0.146195
H 3.120094 0.214780 -1.736452
H 0.096324 2.141937 1.424907
H -0.294183 3.053916 -0.050203
H 1.422392 -2.830977 -0.807870
H 1.732753 -2.395147 0.867996
H 3.992625 -1.928182 0.258447
H 3.611608 -2.104638 -1.469192
H 1.400822 0.467738 2.260375
H 2.774738 -0.625901 1.948391
H 3.022945 1.129641 1.952517
H -2.949590 1.731433 -1.733310
H -3.021164 2.957209 -0.441099
H -3.678215 1.108822 2.005412
H -2.006326 0.626167 2.376775
H -2.367383 2.325144 1.946397
H -5.314490 2.109664 -1.333453
H -5.137527 2.068935 0.419303
H -4.432528 -1.899471 -0.381610
H -2.709085 -3.184898 -0.340311
H -6.118801 -0.153992 -0.685116
H 5.386645 1.549556 -2.008320
H 4.217560 2.541713 -1.111518
H 5.894172 2.319567 -0.466927


